ethane;N-(3-ethoxypropyl)-2-(methylamino)acetamide

C10H24N2O2 — CID 91016271

IUPACethane;N-(3-ethoxypropyl)-2-(methylamino)acetamide
SMILESCC.CCOCCCNC(=O)CNC
InChIInChI=1S/C8H18N2O2.C2H6/c1-3-12-6-4-5-10-8(11)7-9-2;1-2/h9H,3-7H2,1-2H3,(H,10,11);1-2H3
InChIKeyNSVBTSYTPINZLP-UHFFFAOYSA-N
MW204.31 g/mol
LogP0.77
Rot. Bonds7

About ethane;N-(3-ethoxypropyl)-2-(methylamino)acetamide

ethane;N-(3-ethoxypropyl)-2-(methylamino)acetamide (PubChem CID 91016271) has the molecular formula C10H24N2O2 and a molecular weight of 204.31 g/mol. Its IUPAC name is ethane;N-(3-ethoxypropyl)-2-(methylamino)acetamide.

Molecular Properties

Compound Nameethane;N-(3-ethoxypropyl)-2-(methylamino)acetamide
PubChem CID91016271
Molecular FormulaC10H24N2O2
Molecular Weight204.31 g/mol
Exact Mass204.18
IUPAC Nameethane;N-(3-ethoxypropyl)-2-(methylamino)acetamide
SMILESCC.CCOCCCNC(=O)CNC
InChIInChI=1S/C8H18N2O2.C2H6/c1-3-12-6-4-5-10-8(11)7-9-2;1-2/h9H,3-7H2,1-2H3,(H,10,11);1-2H3
InChIKeyNSVBTSYTPINZLP-UHFFFAOYSA-N
XLogP0.77
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.31
LogP ≤ 50.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of ethane;N-(3-ethoxypropyl)-2-(methylamino)acetamide?
The IUPAC name of ethane;N-(3-ethoxypropyl)-2-(methylamino)acetamide (CID 91016271) is ethane;N-(3-ethoxypropyl)-2-(methylamino)acetamide.
What is the SMILES notation for ethane;N-(3-ethoxypropyl)-2-(methylamino)acetamide?
The canonical SMILES for ethane;N-(3-ethoxypropyl)-2-(methylamino)acetamide is CC.CCOCCCNC(=O)CNC.
What is the InChIKey of ethane;N-(3-ethoxypropyl)-2-(methylamino)acetamide?
The InChIKey is NSVBTSYTPINZLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O2.C2H6/c1-3-12-6-4-5-10-8(11)7-9-2;1-2/h9H,3-7H2,1-2H3,(H,10,11);1-2H3.
What are the key properties of ethane;N-(3-ethoxypropyl)-2-(methylamino)acetamide?
ethane;N-(3-ethoxypropyl)-2-(methylamino)acetamide has a molecular weight of 204.31 g/mol, XLogP of 0.77, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N-(3-ethoxypropyl)-2-(methylamino)acetamide is sourced from PubChem (CID 91016271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).